tert-butyl-(3,4-dimethylcyclopentyl)oxy-dimethylsilane

C13H28OSi — CID 59121104

IUPACtert-butyl-(3,4-dimethylcyclopentyl)oxy-dimethylsilane
SMILESCC1CC(O[Si](C)(C)C(C)(C)C)CC1C
InChIInChI=1S/C13H28OSi/c1-10-8-12(9-11(10)2)14-15(6,7)13(3,4)5/h10-12H,8-9H2,1-7H3
InChIKeySTVJNSYBSHZORY-UHFFFAOYSA-N
MW228.45 g/mol
LogP4.44
Rot. Bonds2

About tert-butyl-(3,4-dimethylcyclopentyl)oxy-dimethylsilane

tert-butyl-(3,4-dimethylcyclopentyl)oxy-dimethylsilane (PubChem CID 59121104) has the molecular formula C13H28OSi and a molecular weight of 228.45 g/mol. Its IUPAC name is tert-butyl-(3,4-dimethylcyclopentyl)oxy-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-(3,4-dimethylcyclopentyl)oxy-dimethylsilane
PubChem CID59121104
Molecular FormulaC13H28OSi
Molecular Weight228.45 g/mol
Exact Mass228.19
IUPAC Nametert-butyl-(3,4-dimethylcyclopentyl)oxy-dimethylsilane
SMILESCC1CC(O[Si](C)(C)C(C)(C)C)CC1C
InChIInChI=1S/C13H28OSi/c1-10-8-12(9-11(10)2)14-15(6,7)13(3,4)5/h10-12H,8-9H2,1-7H3
InChIKeySTVJNSYBSHZORY-UHFFFAOYSA-N
XLogP4.44
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.45
LogP ≤ 54.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

CID 134858996
CID 134858996
Dilithium;3-(trimethylsilylmethyl)cyclopentan-1-olate
CID 135043509
1-Ethyl-1-(1-cyclopentylethyloxy)-1-silacyclopentane
CID 568263
1-Cyclopentylethyl tributylsilyl ether
CID 568687
1-Ethyl-1-(1-cyclopentylethyloxy)-1-silacyclohexane
CID 575307
1-Cyclopentylethanol, TMS derivative
CID 575925
1-Butyl(dimethyl)silyloxy-1-cyclopentylethane
CID 598636
1-Cyclopentyl-1-tripropylsilyloxyethane
CID 614813
(1-Cyclopentylethoxy)(diisopropyl)silane
CID 6329023
Dimethyl(1-cyclopentylethoxy)silane
CID 6329236
1-Cyclopentylethanol, tert-butyldimethylsilyl ether
CID 91697299
4-Methyl-3-heptanol, tert-butyldimethylsilyl ether
CID 91697323

Frequently Asked Questions

What is the IUPAC name of tert-butyl-(3,4-dimethylcyclopentyl)oxy-dimethylsilane?
The IUPAC name of tert-butyl-(3,4-dimethylcyclopentyl)oxy-dimethylsilane (CID 59121104) is tert-butyl-(3,4-dimethylcyclopentyl)oxy-dimethylsilane.
What is the SMILES notation for tert-butyl-(3,4-dimethylcyclopentyl)oxy-dimethylsilane?
The canonical SMILES for tert-butyl-(3,4-dimethylcyclopentyl)oxy-dimethylsilane is CC1CC(O[Si](C)(C)C(C)(C)C)CC1C.
What is the InChIKey of tert-butyl-(3,4-dimethylcyclopentyl)oxy-dimethylsilane?
The InChIKey is STVJNSYBSHZORY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28OSi/c1-10-8-12(9-11(10)2)14-15(6,7)13(3,4)5/h10-12H,8-9H2,1-7H3.
What are the key properties of tert-butyl-(3,4-dimethylcyclopentyl)oxy-dimethylsilane?
tert-butyl-(3,4-dimethylcyclopentyl)oxy-dimethylsilane has a molecular weight of 228.45 g/mol, XLogP of 4.44, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-(3,4-dimethylcyclopentyl)oxy-dimethylsilane is sourced from PubChem (CID 59121104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).